3-{[3-(2-ethylhexyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-{[(furan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-{[3-(2-ethylhexyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-{[(furan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
3-{[3-(2-ethylhexyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-{[(furan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4618-0289 |
| Compound Name: | 3-{[3-(2-ethylhexyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-{[(furan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 496.65 |
| Molecular Formula: | C25 H28 N4 O3 S2 |
| Smiles: | CCCCC(CC)CN1C(/C(=C/C2=C(NCc3ccco3)N=C3C=CC=CN3C2=O)SC1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5079 |
| logD: | 5.5042 |
| logSw: | -5.3954 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.206 |
| InChI Key: | PCKKHMJYBHOOLL-KRWDZBQOSA-N |